2-nitro-5-piperazin-4-ium-1-yl-phenolate

Systemtic Name: 2-nitro-5-piperazin-4-ium-1-yl-phenolate Openeye Name: 2-nitro-5-piperazin-4-ium-1-yl-phenolate CAS Name: 2-nitro-5-(1-piperazin-4-iumyl)phenolate IUPAC Name: 2-nitro-5-piperazin-4-ium-1-ylphenolate Traditional Name: 2-nitro-5-piperazin-4-ium-1-yl-phenolate Formula: C10H13N3O3 MolecularWeight: 223.22852

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=CC(=C(C=C2)[N+](=O)[O-])[O-]

Isomeric SMILES

C1CN(CC[NH2+]1)C2=CC(=C(C=C2)[N+](=O)[O-])[O-]

InChI

InChI=1S/C10H13N3O3/c14-10-7-8(1-2-9(10)13(15)16)12-5-3-11-4-6-12/h1-2,7,11,14H,3-6H2